Senior Researcher in Computational Materials

hace 4 meses


Barcelona, España Barcelona Supercomputing Center (BSC) A tiempo completo

**Job Reference**:

- 552_24_CASE_M_R3**Position**:

- Senior researcher in computational materials modelling (R3) - AI4S**Closing Date**:

- Friday, 27 September, 2024**Reference**: 552_24_CASE_M_R3**Job title**: Senior researcher in computational materials modelling (R3) - AI4S**About BSC**
- The Barcelona Supercomputing Center - Centro Nacional de Supercomputación (BSC-CNS) is the leading supercomputing center in Spain. It houses MareNostrum, one of the most powerful supercomputers in Europe, was a founding and hosting member of the former European HPC infrastructure PRACE (Partnership for Advanced Computing in Europe), and is now hosting entity for EuroHPC JU, the Joint Undertaking that leads large-scale investments and HPC provision in Europe. The mission of BSC is to research, develop and manage information technologies in order to facilitate scientific progress. BSC combines HPC service provision and R&D into both computer and computational science (life, earth and engineering sciences) under one roof, and currently has over 1000 staff from 60 countries.

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We promote Equity, Diversity and Inclusion, fostering an environment where each and every one of us is appreciated for who we are, regardless of our differences.**Context And Mission**
- The Computer Applications in Science and Engineering (CASE) department is looking for a researcher in ab initio computational materials science to join the BSC Materials Science group. The project will be developed within the framework of the AI4Science Fellowships (AI4S), a talent attraction and retention program at the convergence of HPC and AI aimed at the creation and consolidation of research lines leveraging the computational capabilities of MareNostrum 5.

The funding for these actions/fellowships and contracts comes from the European Union Recovery and Resilience Facility - Next Generation, within the framework of the General Invitation by the public business entity Red.es to participate in the talent attraction and retention programs within Investment 4 of Component 19 of the Recovery, Transformation, and Resilience Plan.

"La financiación de estas actuaciones/becas y contratos, procede del Mecanismo de Recuperación y Resiliencia de la Unión Europea-Next Generation, en el marco de la Invitación General de la entidad pública empresarial Red.es para participar en los programas de atracción y retención del talento dentro de la Inversión 4 del Componente 19 del Plan de Recuperación, Transformación y Resiliencia.**Key Duties**
- Coordination of the materials science team at the BSC-CASE department.
- Leading projects on high-performance computing and computational materials modelling.
- Incorporating machine learning (ML) and artificial intelligence (AI) methods into the group research lines related to materials modelling.
- Interact with academic and industrial collaborators to carry out our collaborative research.
- Contribute to publications of scientific papers and periodic reports.

**Requirements**:

- Education
- PhD in computational materials science and engineering.
- Essential Knowledge and Professional Experience
- Fully independent researcher, with experience as a team leader.
- Experience as a coordinator and/or work package leader in international projects.
- At least 10 years of experience in materials modelling using ab initio and classical atomistic simulation methods. Proven experience calculating the physicochemical properties of alloys and oxides, surfaces and molecular systems.
- Good knowledge of the current state-of-the-art in novel hardware architectures, with a focus on co-design in computational materials science.
- Experience evaluating electronic structure software on existing and emerging experimental hardware platforms.
- Experience with RISC-V-based accelerators.
- Excellent in technical writing and communicating results.
- Additional Knowledge and Professional Experience
- Fluency in English is essential. Proficiency in Spanish and other European languages would be advantageous.
- Active collaboration within the EuroHPC Centre of Excellence ecosystem, with a focus on computational materials science codes and their transition toward the exascale.
- Broad international experience. Extensive network of academic (experimental and theoretical) and industrial collaborators in Europe and beyond.
- Collaboration with code developers, hardware vendors, system integrators and EU co-design projects is desirable.
- Experience in working within interdisciplinary teams and liaising with different stakeholders.
- Experience organising scientific events, such as conferences, workshops and hackathons. Contribution to outreach events directed to the general public.
- Competences
- Good interpersonal skills, including in multi-cultural environments.
- Flexible team player capable of working with others and also independently.
- Problem-solving, pro-a



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